4-Ethylphenyl isocyanate → HCID 58659386, compound
Reaction equation
[CH2:17]([CH3:18])[c:19]1[cH:20][cH:21][c:22]([N:25]=[C:26]=[O:27])[cH:23][cH:24]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([O:13][CH3:14])[n:10][cH:11][cH:12]2)[cH:15][cH:16]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([O:13][CH3:14])[n:10][cH:11][cH:12]2)[cH:15][cH:16]1)[C:26]([NH:25][c:22]1[cH:21][cH:20][c:19]([CH2:17][CH3:18])[cH:24][cH:23]1)=[O:27]Participants
3
Sources & evidence
- ORD record
- ord-d71dfd2a86ba45e58b6b247333e2e78d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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